EE4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N30 | N31 | sing | 1.40Å | 1.36Å | Aromatic |
| N30 | C29 | sing | 1.37Å | 1.36Å | Aromatic |
| N31 | C32 | doub | 1.30Å | 1.35Å | Aromatic |
| C33 | C29 | doub | 1.39Å | 1.44Å | Aromatic |
| C33 | C34 | sing | 1.36Å | 1.40Å | Aromatic |
| C29 | C28 | sing | 1.41Å | 1.41Å | Aromatic |
| C32 | C28 | sing | 1.46Å | 1.45Å | Aromatic |
| C34 | C26 | doub | 1.40Å | 1.42Å | Aromatic |
| C28 | C27 | doub | 1.40Å | 1.42Å | Aromatic |
| C26 | C27 | sing | 1.39Å | 1.42Å | Aromatic |
| C26 | C24 | sing | 1.48Å | 1.48Å | |
| C24 | O25 | doub | 1.22Å | 1.16Å | |
| C24 | N23 | sing | 1.35Å | 1.44Å | |
| N23 | C22 | sing | 1.46Å | 1.56Å | |
| C22 | C21 | sing | 1.54Å | 1.34Å | |
| C22 | C18 | sing | 1.55Å | 1.53Å | |
| C21 | N20 | sing | 1.47Å | 1.61Å | |
| C39 | O38 | sing | 1.43Å | 1.50Å | |
| C18 | N17 | sing | 1.46Å | 1.39Å | |
| C18 | C19 | sing | 1.55Å | 1.55Å | |
| N20 | C19 | sing | 1.48Å | 1.34Å | |
| O38 | C37 | sing | 1.36Å | 1.38Å | |
| N17 | C15 | sing | 1.35Å | 1.50Å | |
| C37 | C40 | doub | 1.39Å | 1.40Å | Aromatic |
| C37 | C35 | sing | 1.39Å | 1.37Å | Aromatic |
| C15 | O16 | doub | 1.22Å | 1.16Å | |
| C15 | C12 | sing | 1.48Å | 1.58Å | |
| F36 | C35 | sing | 1.35Å | 1.36Å | |
| C40 | C41 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | doub | 1.40Å | 1.46Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | C06 | doub | 1.40Å | 1.36Å | Aromatic |
| C12 | C13 | sing | 1.40Å | 1.36Å | Aromatic |
| C10 | C09 | doub | 1.40Å | 1.42Å | Aromatic |
| C41 | C05 | doub | 1.38Å | 1.35Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.42Å | Aromatic |
| C06 | C05 | sing | 1.40Å | 1.43Å | Aromatic |
| C06 | C07 | sing | 1.47Å | 1.52Å | |
| C09 | C14 | sing | 1.40Å | 1.41Å | Aromatic |
| C09 | C07 | sing | 1.48Å | 1.57Å | |
| C05 | O04 | sing | 1.36Å | 1.52Å | |
| C07 | O08 | doub | 1.22Å | 1.21Å | |
| O04 | C03 | sing | 1.43Å | 1.33Å | |
| C03 | C02 | sing | 1.53Å | 1.60Å | |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.08Å | 1.08Å | |
| C21 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C02 | H9 | sing | 1.09Å | 1.10Å | |
| C02 | H10 | sing | 1.09Å | 1.10Å | |
| C03 | H11 | sing | 1.09Å | 1.10Å | |
| C03 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.08Å | 1.08Å | |
| C32 | H19 | sing | 1.08Å | 1.08Å | |
| C33 | H20 | sing | 1.08Å | 1.08Å | |
| C34 | H21 | sing | 1.08Å | 1.08Å | |
| C39 | H22 | sing | 1.09Å | 1.10Å | |
| C39 | H23 | sing | 1.09Å | 1.10Å | |
| C39 | H24 | sing | 1.09Å | 1.10Å | |
| C40 | H25 | sing | 1.08Å | 1.08Å | |
| C41 | H26 | sing | 1.08Å | 1.08Å | |
| N17 | H27 | sing | 0.97Å | 1.00Å | |
| N20 | H28 | sing | 1.01Å | 1.00Å | |
| N23 | H30 | sing | 0.97Å | 1.00Å | |
| N30 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N31 | N30 | C29 | 110.5° | 109.2° |
| N30 | N31 | C32 | 108.7° | 110.1° |
| N31 | N30 | H31 | 124.8° | 125.3° |
| N30 | C29 | C33 | 131.7° | 133.6° |
| N30 | C29 | C28 | 107.7° | 106.7° |
| C29 | N30 | H31 | 124.7° | 125.4° |
| N31 | C32 | C28 | 108.1° | 107.7° |
| N31 | C32 | H19 | 126.0° | 126.1° |
| C29 | C33 | C34 | 119.2° | 120.2° |
| C33 | C29 | C28 | 120.6° | 119.8° |
| C29 | C33 | H20 | 120.4° | 119.9° |
| C33 | C34 | C26 | 120.1° | 120.7° |
| C34 | C33 | H20 | 120.4° | 119.9° |
| C33 | C34 | H21 | 119.9° | 119.7° |
| C29 | C28 | C32 | 105.0° | 106.3° |
| C29 | C28 | C27 | 120.3° | 119.8° |
| C32 | C28 | C27 | 134.7° | 133.9° |
| C28 | C32 | H19 | 126.0° | 126.1° |
| C34 | C26 | C27 | 121.3° | 120.2° |
| C34 | C26 | C24 | 117.5° | 119.9° |
| C26 | C34 | H21 | 120.0° | 119.7° |
| C28 | C27 | C26 | 118.5° | 119.4° |
| C28 | C27 | H18 | 120.8° | 120.3° |
| C27 | C26 | C24 | 121.1° | 119.9° |
| C26 | C27 | H18 | 120.8° | 120.3° |
| C26 | C24 | O25 | 120.0° | 120.0° |
| C26 | C24 | N23 | 120.1° | 120.0° |
| O25 | C24 | N23 | 119.9° | 120.0° |
| C24 | N23 | C22 | 115.5° | 120.0° |
| C24 | N23 | H30 | 122.3° | 120.0° |
| N23 | C22 | C21 | 111.3° | 110.7° |
| N23 | C22 | C18 | 108.8° | 110.7° |
| N23 | C22 | H5 | 108.6° | 110.8° |
| C22 | N23 | H30 | 122.3° | 120.0° |
| C21 | C22 | C18 | 107.2° | 103.0° |
| C22 | C21 | N20 | 108.0° | 107.3° |
| C22 | C21 | H3 | 109.8° | 109.9° |
| C22 | C21 | H4 | 109.8° | 110.0° |
| C21 | C22 | H5 | 111.8° | 110.7° |
| C22 | C18 | N17 | 108.1° | 111.0° |
| C22 | C18 | C19 | 105.2° | 101.7° |
| C18 | C22 | H5 | 109.0° | 110.7° |
| C22 | C18 | H15 | 110.6° | 111.0° |
| C21 | N20 | C19 | 108.1° | 108.6° |
| N20 | C21 | H3 | 109.8° | 109.9° |
| N20 | C21 | H4 | 109.8° | 109.9° |
| C21 | N20 | H28 | 109.8° | 111.0° |
| C39 | O38 | C37 | 114.3° | 117.0° |
| O38 | C39 | H22 | 109.5° | 109.5° |
| O38 | C39 | H23 | 109.5° | 109.4° |
| O38 | C39 | H24 | 109.5° | 109.5° |
| N17 | C18 | C19 | 109.4° | 111.0° |
| C18 | N17 | C15 | 117.0° | 120.0° |
| N17 | C18 | H15 | 112.9° | 110.9° |
| C18 | N17 | H27 | 121.5° | 120.0° |
| C18 | C19 | N20 | 105.8° | 104.8° |
| C19 | C18 | H15 | 110.4° | 111.0° |
| C18 | C19 | H16 | 110.4° | 110.3° |
| C18 | C19 | H17 | 110.4° | 110.4° |
| N20 | C19 | H16 | 110.4° | 110.4° |
| N20 | C19 | H17 | 110.4° | 110.5° |
| C19 | N20 | H28 | 109.8° | 111.0° |
| O38 | C37 | C40 | 120.0° | 120.0° |
| O38 | C37 | C35 | 119.9° | 119.9° |
| N17 | C15 | O16 | 120.0° | 120.0° |
| N17 | C15 | C12 | 118.7° | 120.0° |
| C15 | N17 | H27 | 121.5° | 120.0° |
| C40 | C37 | C35 | 120.1° | 120.1° |
| C37 | C40 | C41 | 119.9° | 120.5° |
| C37 | C40 | H25 | 120.0° | 119.8° |
| C37 | C35 | F36 | 120.9° | 120.1° |
| C37 | C35 | C06 | 120.1° | 119.8° |
| O16 | C15 | C12 | 121.2° | 120.0° |
| C15 | C12 | C11 | 119.1° | 120.0° |
| C15 | C12 | C13 | 119.7° | 120.0° |
| F36 | C35 | C06 | 119.0° | 120.1° |
| C40 | C41 | C05 | 120.0° | 120.2° |
| C41 | C40 | H25 | 120.0° | 119.8° |
| C40 | C41 | H26 | 120.0° | 119.9° |
| C12 | C11 | C10 | 119.6° | 120.0° |
| C11 | C12 | C13 | 121.1° | 120.0° |
| C12 | C11 | H13 | 120.2° | 120.0° |
| C11 | C10 | C09 | 119.1° | 120.0° |
| C11 | C10 | H1 | 120.5° | 120.0° |
| C10 | C11 | H13 | 120.2° | 120.0° |
| C35 | C06 | C05 | 119.7° | 119.6° |
| C35 | C06 | C07 | 118.3° | 120.2° |
| C12 | C13 | C14 | 119.3° | 120.0° |
| C12 | C13 | H2 | 120.4° | 120.0° |
| C10 | C09 | C14 | 120.8° | 120.0° |
| C10 | C09 | C07 | 120.2° | 120.0° |
| C09 | C10 | H1 | 120.5° | 120.1° |
| C41 | C05 | C06 | 120.1° | 119.8° |
| C41 | C05 | O04 | 119.3° | 120.1° |
| C05 | C41 | H26 | 120.0° | 119.9° |
| C13 | C14 | C09 | 120.1° | 120.0° |
| C14 | C13 | H2 | 120.3° | 120.0° |
| C13 | C14 | H14 | 120.0° | 120.0° |
| C05 | C06 | C07 | 122.0° | 120.2° |
| C06 | C05 | O04 | 120.6° | 120.1° |
| C06 | C07 | C09 | 120.4° | 120.0° |
| C06 | C07 | O08 | 120.5° | 120.0° |
| C14 | C09 | C07 | 118.9° | 120.0° |
| C09 | C14 | H14 | 120.0° | 120.0° |
| C09 | C07 | O08 | 119.1° | 120.0° |
| C05 | O04 | C03 | 111.3° | 117.0° |
| O04 | C03 | C02 | 110.7° | 109.5° |
| O04 | C03 | H11 | 109.1° | 109.4° |
| O04 | C03 | H12 | 109.2° | 109.5° |
| C03 | C02 | C01 | 111.1° | 109.4° |
| C03 | C02 | H9 | 109.0° | 109.5° |
| C03 | C02 | H10 | 109.1° | 109.5° |
| C02 | C03 | H11 | 109.2° | 109.5° |
| C02 | C03 | H12 | 109.2° | 109.5° |
| C02 | C01 | H6 | 109.5° | 109.5° |
| C02 | C01 | H7 | 109.5° | 109.5° |
| C02 | C01 | H8 | 109.5° | 109.5° |
| C01 | C02 | H9 | 109.1° | 109.5° |
| C01 | C02 | H10 | 109.1° | 109.4° |
| H3 | C21 | H4 | 109.5° | 109.8° |
| H6 | C01 | H7 | 109.4° | 109.5° |
| H6 | C01 | H8 | 109.4° | 109.4° |
| H7 | C01 | H8 | 109.5° | 109.5° |
| H9 | C02 | H10 | 109.5° | 109.5° |
| H11 | C03 | H12 | 109.5° | 109.5° |
| H16 | C19 | H17 | 109.5° | 110.3° |
| H22 | C39 | H23 | 109.4° | 109.5° |
| H22 | C39 | H24 | 109.5° | 109.5° |
| H23 | C39 | H24 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N31 | N30 | C29 | H31 | 180.0° | 180.0° |
| N31 | N30 | C29 | C33 | 179.5° | 179.4° |
| N31 | N30 | C29 | C28 | 0.5° | 0.1° |
| N30 | N31 | C32 | C28 | 0.2° | 0.0° |
| N30 | N31 | C32 | H19 | 179.8° | 180.0° |
| C29 | N30 | N31 | C32 | 0.2° | 0.1° |
| N30 | C29 | C33 | C28 | 178.9° | 179.4° |
| N30 | C29 | C33 | C34 | 179.7° | 179.8° |
| N30 | C29 | C28 | C32 | 0.6° | 0.0° |
| N30 | C29 | C28 | C27 | 179.8° | 180.0° |
| N30 | C29 | C33 | H20 | 0.3° | 0.6° |
| N31 | C32 | C28 | C29 | 0.5° | 0.0° |
| N31 | C32 | C28 | H19 | 180.0° | 180.0° |
| N31 | C32 | C28 | C27 | 180.0° | 180.0° |
| C32 | N31 | N30 | H31 | 179.9° | 180.0° |
| C29 | C33 | C34 | H20 | 180.0° | 179.2° |
| C33 | C29 | C28 | C32 | 179.7° | 179.5° |
| C29 | C33 | C34 | C26 | 1.4° | 0.6° |
| C33 | C29 | C28 | C27 | 0.7° | 0.5° |
| C29 | C33 | C34 | H21 | 178.7° | 179.4° |
| C33 | C29 | N30 | H31 | 0.5° | 0.6° |
| C34 | C33 | C29 | C28 | 0.8° | 0.8° |
| C33 | C34 | C26 | H21 | 180.0° | 180.0° |
| C33 | C34 | C26 | C27 | 1.8° | 0.0° |
| C33 | C34 | C26 | C24 | 178.8° | 179.7° |
| C29 | C28 | C32 | C27 | 179.5° | 180.0° |
| C29 | C28 | C27 | C26 | 1.0° | 0.0° |
| C29 | C28 | C27 | H18 | 179.0° | 180.0° |
| C29 | C28 | C32 | H19 | 179.5° | 180.0° |
| C28 | C29 | C33 | H20 | 179.2° | 180.0° |
| C28 | C29 | N30 | H31 | 179.6° | 180.0° |
| C32 | C28 | C27 | C26 | 179.5° | 180.0° |
| C32 | C28 | C27 | H18 | 0.5° | 0.0° |
| C34 | C26 | C27 | C28 | 1.6° | 0.3° |
| C34 | C26 | C27 | C24 | 177.0° | 179.8° |
| C34 | C26 | C24 | O25 | 17.3° | 179.7° |
| C34 | C26 | C24 | N23 | 159.2° | 0.2° |
| C34 | C26 | C27 | H18 | 178.4° | 179.8° |
| C26 | C34 | C33 | H20 | 178.7° | 179.8° |
| C28 | C27 | C26 | H18 | 180.0° | 180.0° |
| C28 | C27 | C26 | C24 | 178.6° | 180.0° |
| C27 | C28 | C32 | H19 | 0.0° | 0.0° |
| C27 | C26 | C24 | O25 | 165.6° | 0.0° |
| C27 | C26 | C24 | N23 | 17.9° | 180.0° |
| C27 | C26 | C34 | H21 | 178.2° | 180.0° |
| C26 | C24 | O25 | N23 | 176.6° | 180.0° |
| C26 | C24 | N23 | C22 | 177.9° | 180.0° |
| C24 | C26 | C27 | H18 | 1.5° | 0.0° |
| C24 | C26 | C34 | H21 | 1.2° | 0.3° |
| C26 | C24 | N23 | H30 | 2.1° | 0.1° |
| O25 | C24 | N23 | C22 | 1.4° | 0.0° |
| O25 | C24 | N23 | H30 | 178.7° | 180.0° |
| C24 | N23 | C22 | H30 | 180.0° | 179.9° |
| C24 | N23 | C22 | C21 | 153.5° | 86.5° |
| C24 | N23 | C22 | C18 | 88.5° | 159.9° |
| C24 | N23 | C22 | H5 | 30.0° | 36.7° |
| N23 | C22 | C21 | C18 | 118.9° | 118.4° |
| N23 | C22 | C21 | H5 | 121.7° | 123.3° |
| N23 | C22 | C18 | H5 | 118.3° | 123.3° |
| N23 | C22 | C21 | N20 | 110.2° | 140.7° |
| N23 | C22 | C18 | N17 | 142.5° | 87.9° |
| N23 | C22 | C18 | C19 | 100.7° | 154.0° |
| N23 | C22 | C21 | H3 | 9.6° | 21.2° |
| N23 | C22 | C21 | H4 | 130.1° | 99.9° |
| N23 | C22 | C18 | H15 | 18.5° | 35.9° |
| C21 | C22 | C18 | H5 | 121.2° | 118.3° |
| C22 | C21 | N20 | H3 | 119.8° | 119.5° |
| C22 | C21 | N20 | H4 | 119.8° | 119.5° |
| C21 | C22 | C18 | N17 | 97.0° | 153.8° |
| C21 | C22 | C18 | C19 | 19.8° | 35.6° |
| C22 | C21 | N20 | C19 | 7.1° | 0.9° |
| C22 | C21 | H3 | H4 | 120.6° | 121.1° |
| C21 | C22 | C18 | H15 | 139.0° | 82.5° |
| C22 | C21 | N20 | H28 | 126.9° | 121.3° |
| C21 | C22 | N23 | H30 | 26.5° | 93.6° |
| C18 | C22 | C21 | N20 | 8.7° | 22.3° |
| C22 | C18 | N17 | C19 | 114.0° | 112.3° |
| C22 | C18 | N17 | H15 | 122.6° | 123.8° |
| C22 | C18 | C19 | H15 | 119.3° | 118.1° |
| C22 | C18 | C19 | N20 | 24.3° | 37.0° |
| C22 | C18 | N17 | C15 | 153.3° | 155.0° |
| C18 | C22 | C21 | H3 | 128.5° | 97.2° |
| C18 | C22 | C21 | H4 | 111.0° | 141.8° |
| C22 | C18 | C19 | H16 | 143.7° | 81.8° |
| C22 | C18 | C19 | H17 | 95.1° | 156.0° |
| C22 | C18 | N17 | H27 | 26.7° | 25.0° |
| C18 | C22 | N23 | H30 | 91.5° | 20.0° |
| C21 | N20 | C19 | C18 | 19.1° | 24.0° |
| C21 | N20 | C19 | H28 | 119.8° | 122.2° |
| N20 | C21 | H3 | H4 | 120.7° | 121.0° |
| N20 | C21 | C22 | H5 | 128.1° | 96.0° |
| C21 | N20 | C19 | H16 | 138.5° | 94.8° |
| C21 | N20 | C19 | H17 | 100.4° | 143.0° |
| C39 | O38 | C37 | C40 | 16.3° | 0.0° |
| C39 | O38 | C37 | C35 | 164.3° | 179.7° |
| O38 | C39 | H22 | H23 | 120.0° | 120.0° |
| O38 | C39 | H22 | H24 | 120.0° | 120.0° |
| O38 | C39 | H23 | H24 | 120.0° | 119.9° |
| N17 | C18 | C19 | H15 | 124.8° | 123.8° |
| N17 | C18 | C19 | N20 | 91.6° | 155.1° |
| C18 | N17 | C15 | H27 | 180.0° | 180.0° |
| C18 | N17 | C15 | O16 | 0.5° | 0.0° |
| C18 | N17 | C15 | C12 | 179.3° | 180.0° |
| N17 | C18 | C22 | H5 | 24.2° | 35.4° |
| N17 | C18 | C19 | H16 | 27.8° | 36.3° |
| N17 | C18 | C19 | H17 | 149.0° | 85.9° |
| C18 | C19 | N20 | H16 | 119.4° | 118.8° |
| C18 | C19 | N20 | H17 | 119.4° | 118.9° |
| C19 | C18 | N17 | C15 | 92.7° | 92.7° |
| C19 | C18 | C22 | H5 | 141.0° | 82.7° |
| C18 | C19 | H16 | H17 | 121.7° | 122.2° |
| C19 | C18 | N17 | H27 | 87.3° | 87.3° |
| C18 | C19 | N20 | H28 | 138.9° | 98.2° |
| C19 | N20 | C21 | H3 | 112.7° | 120.4° |
| C19 | N20 | C21 | H4 | 126.9° | 118.6° |
| N20 | C19 | C18 | H15 | 143.6° | 81.1° |
| N20 | C19 | H16 | H17 | 121.7° | 122.4° |
| O38 | C37 | C40 | C35 | 179.3° | 179.8° |
| O38 | C37 | C35 | F36 | 0.6° | 0.2° |
| O38 | C37 | C40 | C41 | 179.7° | 180.0° |
| O38 | C37 | C35 | C06 | 179.7° | 179.7° |
| C37 | O38 | C39 | H22 | 180.0° | 180.0° |
| C37 | O38 | C39 | H23 | 60.0° | 60.0° |
| C37 | O38 | C39 | H24 | 60.0° | 59.9° |
| O38 | C37 | C40 | H25 | 0.3° | 0.3° |
| N17 | C15 | O16 | C12 | 178.8° | 180.0° |
| N17 | C15 | C12 | C11 | 10.6° | 180.0° |
| N17 | C15 | C12 | C13 | 170.3° | 0.0° |
| C15 | N17 | C18 | H15 | 30.7° | 31.2° |
| C40 | C37 | C35 | F36 | 179.9° | 180.0° |
| C37 | C40 | C41 | H25 | 180.0° | 179.7° |
| C40 | C37 | C35 | C06 | 0.3° | 0.1° |
| C37 | C40 | C41 | C05 | 0.3° | 0.5° |
| C37 | C40 | C41 | H26 | 179.7° | 180.0° |
| C37 | C35 | F36 | C06 | 179.8° | 179.9° |
| C35 | C37 | C40 | C41 | 0.4° | 0.2° |
| C37 | C35 | C06 | C05 | 0.2° | 0.1° |
| C37 | C35 | C06 | C07 | 179.4° | 180.0° |
| C35 | C37 | C40 | H25 | 179.6° | 180.0° |
| O16 | C15 | C12 | C11 | 168.3° | 0.0° |
| O16 | C15 | C12 | C13 | 10.8° | 180.0° |
| O16 | C15 | N17 | H27 | 179.5° | 180.0° |
| C15 | C12 | C11 | C13 | 179.1° | 180.0° |
| C15 | C12 | C11 | C10 | 179.3° | 180.0° |
| C15 | C12 | C13 | C14 | 179.4° | 179.7° |
| C15 | C12 | C13 | H2 | 0.6° | 0.3° |
| C15 | C12 | C11 | H13 | 0.7° | 0.1° |
| C12 | C15 | N17 | H27 | 0.6° | 0.0° |
| F36 | C35 | C06 | C05 | 179.9° | 180.0° |
| F36 | C35 | C06 | C07 | 0.3° | 0.1° |
| C40 | C41 | C05 | H26 | 180.0° | 179.4° |
| C40 | C41 | C05 | C06 | 0.1° | 0.5° |
| C40 | C41 | C05 | O04 | 179.4° | 179.7° |
| C12 | C11 | C10 | H13 | 180.0° | 179.9° |
| C12 | C11 | C10 | C09 | 0.2° | 0.1° |
| C11 | C12 | C13 | C14 | 0.3° | 0.3° |
| C12 | C11 | C10 | H1 | 179.8° | 179.7° |
| C11 | C12 | C13 | H2 | 179.7° | 179.6° |
| C10 | C11 | C12 | C13 | 0.2° | 0.1° |
| C11 | C10 | C09 | H1 | 180.0° | 179.8° |
| C11 | C10 | C09 | C14 | 0.3° | 0.2° |
| C11 | C10 | C09 | C07 | 180.0° | 179.7° |
| C35 | C06 | C05 | C41 | 0.1° | 0.2° |
| C35 | C06 | C05 | C07 | 179.6° | 179.9° |
| C35 | C06 | C07 | C09 | 72.0° | 85.2° |
| C35 | C06 | C05 | O04 | 179.4° | 180.0° |
| C35 | C06 | C07 | O08 | 107.3° | 94.7° |
| C12 | C13 | C14 | H2 | 180.0° | 179.4° |
| C12 | C13 | C14 | C09 | 0.4° | 0.6° |
| C13 | C12 | C11 | H13 | 179.8° | 180.0° |
| C12 | C13 | C14 | H14 | 179.6° | 180.0° |
| C10 | C09 | C14 | C13 | 0.4° | 0.6° |
| C10 | C09 | C07 | C06 | 28.8° | 174.6° |
| C10 | C09 | C14 | C07 | 179.7° | 179.9° |
| C10 | C09 | C07 | O08 | 151.9° | 5.3° |
| C09 | C10 | C11 | H13 | 179.8° | 180.0° |
| C10 | C09 | C14 | H14 | 179.6° | 179.9° |
| C41 | C05 | C06 | O04 | 179.3° | 179.8° |
| C41 | C05 | C06 | C07 | 179.5° | 179.7° |
| C41 | C05 | O04 | C03 | 97.3° | 0.3° |
| C05 | C41 | C40 | H25 | 179.7° | 179.7° |
| C13 | C14 | C09 | H14 | 180.0° | 179.4° |
| C13 | C14 | C09 | C07 | 179.9° | 179.3° |
| C05 | C06 | C07 | C09 | 108.4° | 94.9° |
| C05 | C06 | C07 | O08 | 72.3° | 85.2° |
| C06 | C05 | O04 | C03 | 82.0° | 179.9° |
| C06 | C05 | C41 | H26 | 179.9° | 179.9° |
| C06 | C07 | C09 | C14 | 150.9° | 5.5° |
| C06 | C07 | C09 | O08 | 179.3° | 179.9° |
| C07 | C06 | C05 | O04 | 0.2° | 0.0° |
| C14 | C09 | C07 | O08 | 28.4° | 174.6° |
| C14 | C09 | C10 | H1 | 179.7° | 180.0° |
| C09 | C14 | C13 | H2 | 179.6° | 180.0° |
| C07 | C09 | C10 | H1 | 0.0° | 0.1° |
| C07 | C09 | C14 | H14 | 0.1° | 0.0° |
| C05 | O04 | C03 | C02 | 123.1° | 180.0° |
| C05 | O04 | C03 | H11 | 2.9° | 60.0° |
| C05 | O04 | C03 | H12 | 116.7° | 60.0° |
| O04 | C05 | C41 | H26 | 0.6° | 0.3° |
| O04 | C03 | C02 | H11 | 120.2° | 119.9° |
| O04 | C03 | C02 | H12 | 120.2° | 120.0° |
| O04 | C03 | C02 | C01 | 169.3° | 180.0° |
| O04 | C03 | C02 | H9 | 49.1° | 60.1° |
| O04 | C03 | C02 | H10 | 70.4° | 60.0° |
| O04 | C03 | H11 | H12 | 119.4° | 120.0° |
| C03 | C02 | C01 | H9 | 120.2° | 120.0° |
| C03 | C02 | C01 | H10 | 120.2° | 120.0° |
| C03 | C02 | C01 | H6 | 180.0° | 60.0° |
| C03 | C02 | C01 | H7 | 60.0° | 60.0° |
| C03 | C02 | C01 | H8 | 60.0° | 180.0° |
| C03 | C02 | H9 | H10 | 119.2° | 120.1° |
| C02 | C03 | H11 | H12 | 119.5° | 120.0° |
| C02 | C01 | H6 | H7 | 120.0° | 120.0° |
| C02 | C01 | H6 | H8 | 120.0° | 120.0° |
| C02 | C01 | H7 | H8 | 120.0° | 120.0° |
| C01 | C02 | H9 | H10 | 119.3° | 120.0° |
| C01 | C02 | C03 | H11 | 70.5° | 60.0° |
| C01 | C02 | C03 | H12 | 49.1° | 60.0° |
| H1 | C10 | C11 | H13 | 0.2° | 0.2° |
| H2 | C13 | C14 | H14 | 0.4° | 0.7° |
| H3 | C21 | C22 | H5 | 112.1° | 144.5° |
| H3 | C21 | N20 | H28 | 7.1° | 1.8° |
| H4 | C21 | C22 | H5 | 8.4° | 23.4° |
| H4 | C21 | N20 | H28 | 113.4° | 119.2° |
| H5 | C22 | C18 | H15 | 99.8° | 159.2° |
| H5 | C22 | N23 | H30 | 150.0° | 143.2° |
| H6 | C01 | H7 | H8 | 120.0° | 120.0° |
| H6 | C01 | C02 | H9 | 59.8° | 60.0° |
| H6 | C01 | C02 | H10 | 59.7° | 180.0° |
| H7 | C01 | C02 | H9 | 179.8° | 180.0° |
| H7 | C01 | C02 | H10 | 60.2° | 60.0° |
| H8 | C01 | C02 | H9 | 60.2° | 60.0° |
| H8 | C01 | C02 | H10 | 179.7° | 60.0° |
| H9 | C02 | C03 | H11 | 169.2° | 180.0° |
| H9 | C02 | C03 | H12 | 71.1° | 60.0° |
| H10 | C02 | C03 | H11 | 49.7° | 59.9° |
| H10 | C02 | C03 | H12 | 169.4° | 180.0° |
| H15 | C18 | C19 | H16 | 97.0° | 160.1° |
| H15 | C18 | C19 | H17 | 24.2° | 37.9° |
| H15 | C18 | N17 | H27 | 149.3° | 148.8° |
| H16 | C19 | N20 | H28 | 101.7° | 143.0° |
| H17 | C19 | N20 | H28 | 19.4° | 20.7° |
| H20 | C33 | C34 | H21 | 1.3° | 0.2° |
| H22 | C39 | H23 | H24 | 120.0° | 120.0° |
| H25 | C40 | C41 | H26 | 0.3° | 0.3° |
